Thermoelectric efficiency of nanowires with long range surface disorder

Cataloged from PDF version of article.The electron transmission plays an important role in the design of thermoelectric devices made up from silicon nanowires. It has been shown that the transmission spectra of a rough silicon wire can be modified by introducing long-range correlations to its disordered surface. Although using the linear response theory in determining the efficiency of the possible heat engine device based on silicon nanowires is useful to point out the overall behavior with respect to the continuous incident electron energy, it says nothing about its performance as a heat engine. Actually, the energy value at which the engine optimally works should be determined from its power output. So, a nonlinear thermodynamic method is necessary to find the efficiency and power output concurrently. The efficiency at the maximum power shows that some nanowires with specific surface disorder structure are more appropriate to use as heat engines than others. The possibility of engineering the transmission of electrons in the nanowires to increase their efficiency maybe an answer to the demand of highly efficient thermoelectric semiconductor materials in future

Bioactive supramolecular peptide nanofibers for regenerative medicine

Cataloged from PDF version of article.Recent advances in understanding of cell-matrix interactions and the role of the extracellular matrix (ECM) in regulation of cellular behavior have created new perspectives for regenerative medicine. Supramolecular peptide nanofiber systems have been used as synthetic scaffolds in regenerative medicine applications due to their tailorable properties and ability to mimic ECM proteins. Through designed bioactive epitopes, peptide nanofiber systems provide biomolecular recognition sites that can trigger specific interactions with cell surface receptors. The present Review covers structural and biochemical properties of the self-assembled peptide nanofibers for tissue regeneration, and highlights studies that investigate the ability of ECM mimetic peptides to alter cellular behavior including cell adhesion, proliferation, and/or differentiation. © 2014 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim

Magic structures of helical multi-shell zirconium nanowires

The structures of free-standing zirconium nanowires with 0.6$-$2.8 nm in diameter are systematically studied by using genetic algorithm simulations with a tight-binding many body potential. Several multi-shell growth sequences with cylindrical structures are obtained. These multi-shell structures are composed of coaxial atomic shells with the three- and four-strands helical, centered pentagonal and hexagonal, and parallel double-chain-core curved surface epitaxy. Under the same growth sequence, the numbers of atomic strands in inner- and outer-shell show even-odd coupling and usually differ by five. The size and structure dependence of angular correlation functions and vibrational properties of zirconium nanowire are also discussed.Comment: 14 pages, 4 figure

Understanding the plasmonic properties of dewetting formed Ag nanoparticles for large area solar cell applications

Cataloged from PDF version of article.The effects of substrates with technological interest for solar cell industry are examined on the plasmonic properties of Ag nanoparticles fabricated by dewetting technique. Both surface matching (boundary element) and propagator (finite difference time domain) methods are used in numerical simulations to describe plasmonic properties and to interpret experimental data. The uncertainty on the locations of nanoparticles by the substrate in experiment is explained by the simulations of various Ag nanoparticle configurations. The change in plasmon resonance due to the location of nanoparticles with respect to the substrate, interactions among them, their shapes, and sizes as well as dielectric properties of substrate are discussed theoretically and implications of these for the experiment are deliberated. (C) 2013 Optical Society of Americ

Synthesis of Phosporus Included Multiwalled Carbon Nanotubes by Pyrolysis of Sucrose

Cataloged from PDF version of article.Multiwalled carbon nanotubes (MWCNT) were synthesized by a pyrolysis route which involves a dehydration step using phosphoric acid. The resultants were found to be mostly containing amorphous carbon with scattered MWCNTs using scanning electron and transmission electron microscopy techniques. These MWCNTs were smaller in size and limited in quantity compared to the ones synthesized using other common precursors. Energy dispersive X-ray and electron energy loss spectroscopy analysis indicated the presence of phosphorus both at the MWCNT sidewalls and in the catalyst particles encapsulated inside the MWCNTs. In addition, a comparative investigation for sulfur and phosphorus inclusion to the sidewalls of MWCNTs was carried out using density functional theory calculations. The results of the computational study showed that both phosphorus and sulfur atoms prefer to bind among themselves rather than adsorbing directly on carbon nanotubes (CNT). Furthermore, cluster calculations revealed that phosphorus atoms more likely form carbonaceous clusters which result in a decrease in the number of free carbon atoms that can be used for CNT formation. Therefore, we concluded that MWCNT growth might be hindered (promoted) in a phosphorus (sulfur) rich environment which results in needle like phosphorus containing MWCNTs

Biocompatible Supramolecular Catalytic One-Dimensional Nanofibers for Efficient Labeling of Live Cells

Understanding complex cellular functions requires study and tracking of biomolecules such as proteins, glycans, and lipids in their natural environment. Herein, we report the first supramolecular nanocatalyst for bioorthogonal click reaction to label live cells. This biocompatible and biodegradable nanocatalyst was formed by self-assembled peptide nanofibers complexed with copper ions. The supramolecular nanocatalyst enhanced azide-alkyne cycloaddition reaction rate under physiological conditions and was shown to be useful for efficient bioorthogonal labeling of live cells. © 2015 American Chemical Society

Catalytic supramolecular self-assembled peptide nanostructures for ester hydrolysis

Essential amino acids in catalytic sites of native enzymes are important in nature inspired catalyst designs. Active sites of enzymes contain the coordinated assembly of multiple amino acids, and catalytic action is generated by the dynamic interactions among multiple residues. However, catalysis studies are limited by the complex and dynamic structure of the enzyme; and it is difficult to exclusively attribute a given function to a specific residue. Minimalistic approaches involving artificial catalytic sites are promising for the investigation of the enzyme function in the absence of non-essential protein components, and self-assembling peptide nanostructures are especially advantageous in this context. Here we demonstrate the design and characterization of an enzyme-mimetic catalytic nanosystem presenting essential residues (Ser, His, Asp). The function of each residue and its combinations on the nanostructures in hydrolysis reaction was studied. The catalytic self-assembled nanostructures were used for efficient ester hydrolysis such as a model substrate (pNPA) and a natural substrate (acetylcholine) highlighting the key role of self-assembly in catalytic domain formation to test the efficiency of the de novo designed catalyst as a catalytic triad model. © The Royal Society of Chemistry 2016

Melting behavior of ultrathin titanium nanowires

The thermal stability and melting behavior of ultrathin titanium nanowires with multi-shell cylindrical structures are studied using molecular dynamic simulation. The melting temperatures of titanium nanowires show remarkable dependence on wire sizes and structures. For the nanowire thinner than 1.2 nm, there is no clear characteristic of first-order phase transition during the melting, implying a coexistence of solid and liquid phases due to finite size effect. An interesting structural transformation from helical multi-shell cylindrical to bulk-like rectangular is observed in the melting process of a thicker hexagonal nanowire with 1.7 nm diameter.Comment: 4 pages, 4 figure

Alkaline phosphatase-mimicking peptide nanofibers for osteogenic differentiation

Recognition of molecules and regulation of extracellular matrix synthesis are some of the functions of enzymes in addition to their catalytic activity. While a diverse array of enzyme-like materials have been developed, these efforts have largely been confined to the imitation of the chemical structure and catalytic activity of the enzymes, and it is unclear whether enzyme-mimetic molecules can also be used to replicate the matrix-regulatory roles ordinarily performed by natural enzymes. Self-assembled peptide nanofibers can provide multifunctional enzyme-mimetic properties, as the active sequences of the target enzymes can be directly incorporated into the peptides. Here, we report enhanced bone regeneration efficiency through peptide nanofibers carrying both catalytic and matrix-regulatory functions of alkaline phosphatase, a versatile enzyme that plays a critical role in bone formation by regulating phosphate homeostasis and calcifiable bone matrix formation. Histidine presenting peptide nanostructures were developed to function as phosphatases. These molecules are able to catalyze phosphate hydrolysis and serve as bone-like nodule inducing scaffolds. Alkaline phosphatase-like peptide nanofibers enabled osteogenesis for both osteoblast-like and mesenchymal cell lines. © 2015 American Chemical Society

Structure of aluminum atomic chains

First-principles density functional calculations reveal that aluminum can form planar chains in zigzag and ladder structures. The most stable one has equilateral triangular geometry with four nearest neighbors; the other stable zigzag structure has wide bond angle and allows for two nearest neighbors. An intermediary structure has the ladder geometry and is formed by two strands. All these planar geometries are, however, more favored energetically than the linear chain. We found that by going from bulk to a chain the character of bonding changes and acquires directionality. The conductance of zigzag and linear chains is 4e^2/h under ideal ballistic conditions.Comment: modified detailed version, one new structure added, 4 figures, modified figure1, 1 tabl